Pyridine;[3,6,8-tris(dimethylsulfamoyl)pyren-1-yl] dihydrogen phosphate

Base Information

• Chemical Name: Pyridine;[3,6,8-tris(dimethylsulfamoyl)pyren-1-yl] dihydrogen phosphate
• CAS No.: 127044-61-5
• Molecular Formula: C26H28N3O10PS3
• Molecular Weight: 669.68
• European Community (EC) Number: 635-037-7
• DSSTox Substance ID: DTXSID30585032
• Mol file: 127044-61-5.mol

Synonyms:127044-61-5;Pyridine;[3,6,8-tris(dimethylsulfamoyl)pyren-1-yl] dihydrogen phosphate;SCHEMBL591028;DTXSID30585032;3,6,8-Tris(dimethylsulfamoyl)pyren-1-yl dihydrogen phosphate--pyridine (1/1)

Chemical Property of Pyridine;[3,6,8-tris(dimethylsulfamoyl)pyren-1-yl] dihydrogen phosphate

Chemical Property:

• PSA: 223.50000
• LogP: 6.28360
• Storage Temp.: −20°C
• Solubility.: H2O: soluble
• Hydrogen Bond Donor Count: 2
• Hydrogen Bond Acceptor Count: 14
• Rotatable Bond Count: 8
• Exact Mass: 698.09399372
• Heavy Atom Count: 45
• Complexity: 1330

Purity/Quality:

99%min ^*data from raw suppliers

Safty Information:

• Pictogram(s): Xi
• Hazard Codes: Xi
• Statements: 36/37/38
• Safety Statements: 26-36

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CN(C)S(=O)(=O)C1=CC(=C2C=CC3=C(C=C(C4=C3C2=C1C=C4)OP(=O)(O)O)S(=O)(=O)N(C)C)S(=O)(=O)N(C)C.C1=CC=NC=C1